SCHEMBL8030439

SCHEMBL8030439

CC(C)(C)OC(=O)NC1=NC2(c3ccccc3F)C[C@H](CO)OCC2CS1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 15/20 0.44
RORC P51449 5/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2619862 1.00 BACE1 (0.44) BACE1RORC
SCHEMBL2622836 0.93 BACE1 (0.39) BACE1RORC
SCHEMBL2619876 0.93 BACE1 (0.42) BACE1
SCHEMBL2619869 0.92 BACE1 (0.47) BACE1RORC
SCHEMBL2619863 0.89 BACE1 (0.38) BACE1RORC
SCHEMBL2934179 0.87 BACE1 (0.48) BACE1
SCHEMBL14734508 0.86 BACE1 (0.61) BACE1
SCHEMBL2632274 0.84 BACE1 (0.38) BACE1
SCHEMBL2620043 0.84 BACE1 (0.38) BACE1
SCHEMBL10288953 0.84 BACE1 (0.38) BACE1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009091016-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-07-23 WO disclosed